SCHEMBL22496896

SCHEMBL22496896

CC(C)(C)C1C(Nc2nc(Cl)nc3[nH]ncc23)CCCN1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BTK Q06187 17/20 0.41
JAK3 P52333 16/20 0.41
PLK4 O00444 1/20 0.36
PAK4 O96013 1/20 0.36
PDE2A O00408 1/20 0.34
PAK1 Q13153 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL22496836 0.84 JAK3 (0.44) BTKJAK3
SCHEMBL22496978 0.81 JAK3 (0.32) BTKJAK3
SCHEMBL22496751 0.80 JAK3 (0.42) BTKJAK3
SCHEMBL22496852 0.80 JAK3 (0.31) BTKJAK3
SCHEMBL22496736 0.80 JAK3 (0.38) BTKJAK3
SCHEMBL2128328 0.79 KMT2A (0.46) BTK
SCHEMBL22497010 0.78 JAK3 (0.42) BTKJAK3
SCHEMBL22496763 0.77 CHUK (0.41) BTKJAK3
SCHEMBL28610635 0.74 BTK (0.53) BTKJAK3PAK1
SCHEMBL28610634 0.74 BTK (0.53) BTKJAK3PAK1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10961247-B2 Pyrazolopyrimidine derivatives as kinase inhibitor DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2021-03-30 US disclosed
US-20200317673-A1 PYRAZOLOPYRIMIDINE DERIVATIVES AS KINASE INHIBITOR DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2020-10-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200317673-A1 PYRAZOLOPYRIMIDINE DERIVATIVES AS KINASE INHIBITOR MAP3K5, MAP3K2, MAPKAPK5 BTK 280/4885JAK3 135/4885PLK4 195/4885
US-10961247-B2 Pyrazolopyrimidine derivatives as kinase inhibitor MAP3K5, MAP3K2, MAPKAPK5 BTK 280/4885JAK3 135/4885PLK4 195/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.